8005-4539 Screening compound: (10Z)-10-[(3,4-dimethoxyphenyl)methylidene]-2,4-dimethyl-10H-indeno[1,2-g]quinoline

8005-4539 Screening compound: (10Z)-10-[(3,4-dimethoxyphenyl)methylidene]-2,4-dimethyl-10H-indeno[1,2-g]quinoline
8005-4539 Screening compound: (10Z)-10-[(3,4-dimethoxyphenyl)methylidene]-2,4-dimethyl-10H-indeno[1,2-g]quinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound 8005-4539
(10Z)-10-[(3,4-dimethoxyphenyl)methylidene]-2,4-dimethyl-10H-indeno[1,2-g]quinoline

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

8005-4539

Molecular Formula

C27H23NO2 (C27 H23 NO2)

Compound Name

(10Z)-10-[(3,4-dimethoxyphenyl)methylidene]-2,4-dimethyl-10H-indeno[1,2-g]quinoline

IUPAC name

(10Z)-10-[(34-dimethoxyphenyl)methylidene]-24-dimethyl-10H-indeno[12-g]quinoline

SMILES

Cc1c(cc(-c(cccc2)c2/C2=C/c(cc3)cc(OC)c3OC)c2c2)c2nc(C)c1

InChI

InChI=1S/C27H23NO2/c1-16-11-17(2)28-25-15-24-22(12-18-9-10-26(29-3)27(13-18)30-4)19-7-5-6-8-20(19)23(24)14-21(16)25/h5-15H,1-4H3

InChI Key

QQYQWFQQXDBUER-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00819788

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.49

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.052

Distribution Coefficient, logD

6.052

Water Solubility, LogSw

-5.83

Polar Surface Area

23.380

Acid Dissociation Constant (pKa)

28.42

Base Dissociation Constant (pKb)

4.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.80

8005-4539 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

C-Met Library (15277 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
Targets:
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 8005-4539 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8005-4539?
Check Price and Availability of 8005-4539, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 8005-4539 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8005-4539
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8005-4539
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 8005-4539 available by request